2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol

C9H15N3O — CID 43498847

IUPAC2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol
SMILESCC(C)(CO)Nc1ccc(N)cn1
InChIInChI=1S/C9H15N3O/c1-9(2,6-13)12-8-4-3-7(10)5-11-8/h3-5,13H,6,10H2,1-2H3,(H,11,12)
InChIKeyOELGIZULAIPKNM-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.85
Rot. Bonds3

About 2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol

2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol (PubChem CID 43498847) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol
PubChem CID43498847
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol
SMILESCC(C)(CO)Nc1ccc(N)cn1
InChIInChI=1S/C9H15N3O/c1-9(2,6-13)12-8-4-3-7(10)5-11-8/h3-5,13H,6,10H2,1-2H3,(H,11,12)
InChIKeyOELGIZULAIPKNM-UHFFFAOYSA-N
XLogP0.85
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol?
The IUPAC name of 2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol (CID 43498847) is 2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol.
What is the SMILES notation for 2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol?
The canonical SMILES for 2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol is CC(C)(CO)Nc1ccc(N)cn1.
What is the InChIKey of 2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol?
The InChIKey is OELGIZULAIPKNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-9(2,6-13)12-8-4-3-7(10)5-11-8/h3-5,13H,6,10H2,1-2H3,(H,11,12).
What are the key properties of 2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol?
2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol has a molecular weight of 181.24 g/mol, XLogP of 0.85, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-2-pyridinyl)amino]-2-methylpropan-1-ol is sourced from PubChem (CID 43498847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).